| SpectraBase Spectrum ID |
4uedpXdgjlO |
| Name |
1-(Bromomethyl)-1-methyl-1,2-dihydro-5H-thiazolo[3,2-A]quinazolin-5-one |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
309.977547155 u |
| Formula |
C12H11BrN2OS |
| InChI |
InChI=1S/C12H11BrN2OS/c1-12(6-13)7-15-9-5-3-2-4-8(9)10(16)14-11(15)17-12/h2-5H,6-7H2,1H3 |
| InChIKey |
HLENBGNYNCWFOX-UHFFFAOYSA-N |
| Molecular Weight |
311.197 g/mol |
| SMILES |
C12=NC(=O)C3=C(N2CC(S1)(CBr)C)C=CC=C3 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.81364 |
![1-(Bromomethyl)-1-methyl-1,2-dihydro-5H-thiazolo[3,2-a]quinazolin-5-one](/api/spectrum/4uedpXdgjlO/structure.png?h=300&w=458 "1-(Bromomethyl)-1-methyl-1,2-dihydro-5H-thiazolo[3,2-a]quinazolin-5-one")
